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Drug Details

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Name:CHEMBL1095001
PubChem ID:46887673
Pathway:Show KEGG pathways
InChI:InChI=1S/C38H50N8O7/c1-37(2,3)24-16-22(17-25(29(24)49)38(4,5)6)14-15-40-26(47)12-13-27(48)45-23-10-8-21(9-11-23)18-41-33-28-34(43-19-42-33)46(20-44-28)36-31(51)30(50)32(53-36)35(52)39-7/h8-11,16-17,19-20,30-32,36,49-51H,12-15,18H2,1-7H3,(H,39,52)(H,40,47)(H,45,48)(H,41,42,43)/t30-,31+,32-,36+/m0/s1
SMILES:CNC(=O)[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCc1ccc(cc1)NC(=O)CCC(=O)NCCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C

Properties:
Formula:C38H50N8O7Atoms:53
Molecular Weight:730.853Rotatable Bonds:17
H-bond Acceptors:15H-bond Donors:7
logP:4.1096
Targets:
Synonyms:
CHEBI:726674
CHEMBL1095001